1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol

C10H12FNO2 — CID 106823611

IUPAC1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol
SMILESCOC1CC(O)(c2cncc(F)c2)C1
InChIInChI=1S/C10H12FNO2/c1-14-9-3-10(13,4-9)7-2-8(11)6-12-5-7/h2,5-6,9,13H,3-4H2,1H3
InChIKeyLZGRWFLILYHRBJ-UHFFFAOYSA-N
MW197.21 g/mol
LogP1.22
Rot. Bonds2

About 1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol

1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol (PubChem CID 106823611) has the molecular formula C10H12FNO2 and a molecular weight of 197.21 g/mol. Its IUPAC name is 1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol.

Molecular Properties

Compound Name1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol
PubChem CID106823611
Molecular FormulaC10H12FNO2
Molecular Weight197.21 g/mol
Exact Mass197.09
IUPAC Name1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol
SMILESCOC1CC(O)(c2cncc(F)c2)C1
InChIInChI=1S/C10H12FNO2/c1-14-9-3-10(13,4-9)7-2-8(11)6-12-5-7/h2,5-6,9,13H,3-4H2,1H3
InChIKeyLZGRWFLILYHRBJ-UHFFFAOYSA-N
XLogP1.22
TPSA42.35 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.21
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol?
The IUPAC name of 1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol (CID 106823611) is 1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol.
What is the SMILES notation for 1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol?
The canonical SMILES for 1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol is COC1CC(O)(c2cncc(F)c2)C1.
What is the InChIKey of 1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol?
The InChIKey is LZGRWFLILYHRBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H12FNO2/c1-14-9-3-10(13,4-9)7-2-8(11)6-12-5-7/h2,5-6,9,13H,3-4H2,1H3.
What are the key properties of 1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol?
1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol has a molecular weight of 197.21 g/mol, XLogP of 1.22, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-fluoro-3-pyridinyl)-3-methoxycyclobutan-1-ol is sourced from PubChem (CID 106823611), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).